3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | F797-0601 |
| Compound Name: | 3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C25 H28 N4 O6 |
| Smiles: | COc1ccc(CCNC(CCN2C=Nc3c4cc(c(cc4[nH]c3C2=O)OC)OC)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 0.7677 |
| logD: | 0.7677 |
| logSw: | -2.0928 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.11 |
| InChI Key: | KPOABICEVMRADM-UHFFFAOYSA-N |